#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ytg s GLN 2 N 0.00 3.27 -0.09 0.54 0.74 -1.26 -5.10 119.66 117.76 1ytg s GLN 2 Ca 0.00 -0.74 0.04 0.00 0.05 0.00 0.00 55.36 54.71 1ytg s GLN 2 Cb 0.00 -2.56 -0.00 0.00 1.10 0.00 0.00 33.01 31.54 1ytg s GLN 2 CO 0.00 0.15 -0.24 0.42 -0.55 0.00 0.00 175.29 175.07 1ytg s ILE 3 N 0.47 2.06 0.28 -2.34 1.01 -1.26 -5.12 121.20 116.31 1ytg s ILE 3 Ca -0.11 -1.03 0.00 0.00 0.00 0.00 0.00 60.65 59.52 1ytg s ILE 3 Cb -0.16 -1.78 -0.04 0.00 0.01 0.00 0.00 42.46 40.50 1ytg s ILE 3 CO 0.05 0.56 0.47 0.42 0.00 0.00 0.00 174.94 176.44 1ytg s THR 4 N 0.28 5.16 -0.40 2.92 -4.23 -1.26 -5.05 115.64 113.05 1ytg s THR 4 Ca -0.17 -0.48 0.16 0.00 -1.18 0.00 0.00 61.69 60.02 1ytg s THR 4 Cb -0.17 -3.81 0.56 0.00 1.34 0.00 0.00 72.50 70.41 1ytg s THR 4 CO 0.08 -0.38 1.47 0.18 -0.54 0.00 0.00 174.62 175.43 1ytg n LEU 5 N -1.30 4.10 -0.07 4.79 4.77 -1.26 -4.34 117.00 123.68 1ytg n LEU 5 Ca -0.05 -2.79 0.03 0.00 -0.03 0.00 0.00 56.01 53.16 1ytg n LEU 5 Cb 0.55 -0.52 0.36 0.00 -2.33 0.00 0.00 43.42 41.48 1ytg n LEU 5 CO 0.48 0.69 1.18 -0.50 -1.33 0.00 0.00 177.39 177.91 1ytg h TRP 6 N 2.39 0.66 -2.02 -1.77 4.06 -2.06 -3.43 115.95 113.77 1ytg h TRP 6 Ca 0.00 0.01 -0.54 0.00 2.06 0.00 0.00 58.89 60.42 1ytg h TRP 6 Cb 1.41 -0.22 -0.07 0.00 -1.00 0.00 0.00 29.16 29.28 1ytg h TRP 6 CO 0.57 0.42 -0.56 0.15 -3.56 0.00 0.00 178.44 175.46 1ytg s LYS 7 N -5.60 2.46 0.29 0.49 1.02 -1.26 -5.08 119.74 112.05 1ytg s LYS 7 Ca -0.09 -1.42 -0.30 0.00 0.02 0.00 0.00 55.97 54.19 1ytg s LYS 7 Cb 0.17 -2.25 -0.11 0.00 -0.52 0.00 0.00 37.83 35.13 1ytg s LYS 7 CO 0.75 0.23 1.50 1.03 -0.92 0.00 0.00 175.35 177.94 1ytg s ARG 8 N -3.80 4.20 -1.38 1.68 0.52 -1.26 -4.89 118.95 114.02 1ytg s ARG 8 Ca 0.35 2.44 -0.15 0.00 -0.52 0.00 0.00 55.73 57.85 1ytg s ARG 8 Cb -0.05 -3.06 0.07 0.00 0.52 0.00 0.00 34.95 32.43 1ytg s ARG 8 CO 0.22 -0.50 1.99 -0.35 0.02 0.00 0.00 175.30 176.68 1ytg n PRO 9 N 1.96 3.07 -3.29 3.54 -0.04 -1.26 -4.93 135.00 134.04 1ytg n PRO 9 Ca 0.06 -2.98 -0.38 0.00 -0.04 0.00 0.00 63.50 60.15 1ytg n PRO 9 Cb 0.39 -3.31 -0.06 0.00 -0.04 0.00 0.00 33.50 30.48 1ytg n PRO 9 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1ytg s LEU 10 N 2.62 4.36 0.10 1.53 1.02 -1.26 -0.52 118.68 126.53 1ytg s LEU 10 Ca 0.48 0.97 0.00 0.00 0.02 0.00 0.00 54.13 55.61 1ytg s LEU 10 Cb 0.09 -2.77 -0.04 0.00 0.02 0.00 0.00 46.19 43.49 1ytg s LEU 10 CO -0.02 0.08 -0.02 0.54 0.02 0.00 0.00 176.35 176.95 1ytg s VAL 11 N 0.09 0.39 -0.20 -1.59 0.11 0.14 -4.89 120.40 114.46 1ytg s VAL 11 Ca 0.28 -1.89 -0.07 0.00 -2.93 0.00 0.00 61.98 57.37 1ytg s VAL 11 Cb -0.17 -1.77 -0.04 0.00 -1.53 0.00 0.00 36.38 32.88 1ytg s VAL 11 CO 0.13 -0.77 0.05 -0.89 -3.33 0.00 0.00 175.10 170.30 1ytg s THR 12 N -3.83 4.58 0.35 5.04 2.01 -1.26 0.46 115.64 123.00 1ytg s THR 12 Ca 0.15 -0.10 0.09 0.00 0.31 0.00 0.00 61.69 62.13 1ytg s THR 12 Cb 0.07 -3.08 -0.06 0.00 0.01 0.00 0.00 72.50 69.44 1ytg s THR 12 CO -0.04 0.43 -0.01 0.27 -0.69 0.00 0.00 174.62 174.59 1ytg s ILE 13 N 0.69 2.47 -0.07 1.82 -4.36 0.74 -3.05 121.20 119.44 1ytg s ILE 13 Ca 0.03 -2.02 -0.01 0.00 -0.26 0.00 0.00 60.65 58.39 1ytg s ILE 13 Cb -0.13 -2.78 0.03 0.00 1.25 0.00 0.00 42.46 40.82 1ytg s ILE 13 CO 0.02 -0.17 -0.01 -0.60 0.24 0.00 0.00 174.94 174.41 1ytg s ARG 14 N -3.70 0.72 -0.10 0.37 3.52 -0.77 -0.84 118.95 118.15 1ytg s ARG 14 Ca 0.35 0.05 -0.09 0.00 -0.13 0.00 0.00 55.73 55.91 1ytg s ARG 14 Cb 0.01 -1.01 0.03 0.00 -1.56 0.00 0.00 34.95 32.42 1ytg s ARG 14 CO 0.19 -0.28 0.26 -1.50 -0.81 0.00 0.00 175.30 173.16 1ytg s ILE 15 N 1.83 -0.00 -0.86 4.11 2.07 -0.59 -1.12 121.20 126.63 1ytg s ILE 15 Ca 0.03 0.00 -0.02 0.00 -1.41 0.00 0.00 60.65 59.26 1ytg s ILE 15 Cb -0.12 -0.37 0.01 0.00 0.13 0.00 0.00 42.46 42.11 1ytg s ILE 15 CO -0.05 0.00 0.09 0.61 -1.91 0.00 0.00 174.94 173.68 1ytg n GLY 16 N 2.98 -0.50 2.59 1.50 0.00 -1.26 -0.29 105.19 110.21 1ytg n GLY 16 Ca -0.13 0.02 0.00 0.00 0.00 0.00 0.00 46.02 45.90 1ytg n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ytg n GLY 17 N -0.80 0.35 3.54 -0.02 0.00 -1.26 -5.01 105.19 102.00 1ytg n GLY 17 Ca -0.09 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 1ytg n GLY 17 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ytg s GLN 18 N -0.73 3.27 -0.07 1.61 0.74 0.60 -5.10 119.66 119.97 1ytg s GLN 18 Ca 0.00 -0.53 -0.25 0.00 0.05 0.00 0.00 55.36 54.63 1ytg s GLN 18 Cb 0.00 -2.77 -0.03 0.00 1.10 0.00 0.00 33.01 31.30 1ytg s GLN 18 CO 0.00 0.44 0.78 -0.51 -0.55 0.00 0.00 175.29 175.45 1ytg s LEU 19 N -0.18 4.31 0.11 3.68 1.43 -1.26 -1.55 118.68 125.22 1ytg s LEU 19 Ca 0.03 1.29 0.01 0.00 -1.03 0.00 0.00 54.13 54.43 1ytg s LEU 19 Cb -0.13 -3.21 -0.04 0.00 0.03 0.00 0.00 46.19 42.84 1ytg s LEU 19 CO 0.03 -0.19 -0.04 -0.54 0.23 0.00 0.00 176.35 175.83 1ytg s LYS 20 N 1.06 0.86 0.08 1.70 1.02 -0.02 -4.96 119.74 119.48 1ytg s LYS 20 Ca 0.41 -1.36 -0.02 0.00 0.02 0.00 0.00 55.97 55.02 1ytg s LYS 20 Cb -0.18 -0.13 -0.05 0.00 -0.52 0.00 0.00 37.83 36.95 1ytg s LYS 20 CO 0.19 -0.07 0.26 -1.21 -0.92 0.00 0.00 175.35 173.61 1ytg s GLU 21 N -3.87 3.50 -0.03 1.68 2.02 -1.26 -0.18 118.70 120.56 1ytg s GLU 21 Ca 0.14 -0.31 -0.20 0.00 0.02 0.00 0.00 54.97 54.63 1ytg s GLU 21 Cb 0.06 -2.98 0.04 0.00 0.10 0.00 0.00 34.13 31.34 1ytg s GLU 21 CO -0.03 0.57 0.42 0.00 0.02 0.00 0.00 175.26 176.24 1ytg s ALA 22 N -1.54 -1.09 -0.08 5.21 0.00 0.17 -4.54 121.76 119.91 1ytg s ALA 22 Ca 0.36 0.64 -0.18 0.00 0.00 0.00 0.00 51.96 52.78 1ytg s ALA 22 Cb -0.13 0.04 -0.05 0.00 0.00 0.00 0.00 23.12 22.99 1ytg s ALA 22 CO 0.26 -0.29 0.49 -1.17 0.00 0.00 0.00 175.76 175.04 1ytg s LEU 23 N -1.26 4.34 -0.44 0.00 0.20 0.13 0.29 118.68 121.93 1ytg s LEU 23 Ca -0.13 0.91 -0.26 0.00 0.69 0.00 0.00 54.13 55.34 1ytg s LEU 23 Cb -0.04 -2.72 0.02 0.00 -0.43 0.00 0.00 46.19 43.03 1ytg s LEU 23 CO 0.06 0.08 0.96 -0.76 -0.29 0.00 0.00 176.35 176.39 1ytg s LEU 24 N 0.17 3.95 -0.31 -0.68 1.02 0.32 -0.31 118.68 122.84 1ytg s LEU 24 Ca 0.26 0.27 0.01 0.00 0.02 0.00 0.00 54.13 54.69 1ytg s LEU 24 Cb -0.16 -3.26 0.09 0.00 0.02 0.00 0.00 46.19 42.88 1ytg s LEU 24 CO 0.12 -1.04 0.06 -0.62 0.02 0.00 0.00 176.35 174.89 1ytg s ASP 25 N 2.21 4.26 0.24 2.29 -1.08 -0.90 -4.81 116.67 118.89 1ytg s ASP 25 Ca 0.39 -1.76 0.22 0.00 -0.52 0.00 0.00 52.55 50.88 1ytg s ASP 25 Cb -0.10 -1.19 0.96 0.00 -1.46 0.00 0.00 42.92 41.13 1ytg s ASP 25 CO 0.25 -0.38 1.66 0.35 0.52 0.00 0.00 175.17 177.58 1ytg n THR 26 N 4.61 0.92 0.47 1.71 -2.24 -1.26 -1.94 114.28 116.55 1ytg n THR 26 Ca -0.01 0.34 0.13 0.00 -2.27 0.00 0.00 64.05 62.23 1ytg n THR 26 Cb 0.42 -1.27 0.30 0.00 -2.10 0.00 0.00 70.33 67.68 1ytg n THR 26 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 1ytg h GLY 27 N 1.76 0.00 -5.61 3.38 0.00 -1.94 -3.45 103.07 97.20 1ytg h GLY 27 Ca 0.00 0.00 -0.67 0.00 0.00 0.00 0.00 47.33 46.66 1ytg h GLY 27 CO 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 176.54 176.05 1ytg s ALA 28 N -3.15 3.85 0.13 3.60 0.00 -0.82 -5.00 121.76 120.38 1ytg s ALA 28 Ca 0.09 -0.65 0.02 0.00 0.00 0.00 0.00 51.96 51.42 1ytg s ALA 28 Cb 0.10 -1.94 -0.14 0.00 0.00 0.00 0.00 23.12 21.13 1ytg s ALA 28 CO 0.63 0.62 1.29 -0.44 0.00 0.00 0.00 175.76 177.86 1ytg h ASP 29 N 4.97 0.20 -2.40 0.00 3.32 -1.87 -0.07 116.42 120.58 1ytg h ASP 29 Ca -0.55 -0.19 -0.60 0.00 0.02 0.00 0.00 57.03 55.71 1ytg h ASP 29 Cb 1.23 -0.06 -0.13 0.00 0.22 0.00 0.00 39.33 40.58 1ytg h ASP 29 CO 0.58 1.09 -0.73 -1.81 -1.72 0.00 0.00 179.24 176.65 1ytg s ASP 30 N -6.91 3.90 -0.20 6.45 1.01 -1.26 -2.15 116.67 117.52 1ytg s ASP 30 Ca -0.02 -0.86 -0.14 0.00 0.71 0.00 0.00 52.55 52.25 1ytg s ASP 30 Cb 0.09 -0.49 -0.04 0.00 1.01 0.00 0.00 42.92 43.49 1ytg s ASP 30 CO 0.84 0.04 0.29 -0.89 0.21 0.00 0.00 175.17 175.67 1ytg s THR 31 N -2.28 5.28 -0.03 -1.27 2.01 -1.26 -3.12 115.64 114.96 1ytg s THR 31 Ca 0.29 0.50 0.01 0.00 0.31 0.00 0.00 61.69 62.80 1ytg s THR 31 Cb -0.06 -3.63 0.02 0.00 0.01 0.00 0.00 72.50 68.84 1ytg s THR 31 CO 0.16 0.33 -0.02 0.54 -0.69 0.00 0.00 174.62 174.93 1ytg s VAL 32 N 0.93 0.34 0.15 3.82 0.11 -1.04 -1.42 120.40 123.29 1ytg s VAL 32 Ca 0.15 -0.03 0.10 0.00 -2.93 0.00 0.00 61.98 59.27 1ytg s VAL 32 Cb -0.14 -0.39 -0.04 0.00 -1.53 0.00 0.00 36.38 34.29 1ytg s VAL 32 CO 0.05 0.17 -0.24 -0.76 -3.33 0.00 0.00 175.10 170.99 1ytg s LEU 33 N 0.83 2.37 0.94 2.54 1.43 0.05 -2.05 118.68 124.79 1ytg s LEU 33 Ca -0.09 -0.79 -0.12 0.00 -1.03 0.00 0.00 54.13 52.09 1ytg s LEU 33 Cb -0.13 -1.10 0.05 0.00 0.03 0.00 0.00 46.19 45.05 1ytg s LEU 33 CO -0.01 0.11 0.54 -0.62 0.23 0.00 0.00 176.35 176.60 1ytg n GLU 34 N 0.64 -0.29 -1.66 1.70 1.02 -1.26 -1.04 120.64 119.74 1ytg n GLU 34 Ca -0.16 -0.04 -0.50 0.00 -0.02 0.00 0.00 57.16 56.44 1ytg n GLU 34 Cb 0.55 -1.94 -0.05 0.00 -0.02 0.00 0.00 31.44 29.97 1ytg n GLU 34 CO 0.00 0.00 0.00 -1.91 1.18 0.00 0.00 177.13 176.40 1ytg n GLU 35 N -2.08 1.85 -3.76 3.49 4.07 -1.26 -4.59 120.64 118.36 1ytg n GLU 35 Ca 0.08 0.66 -0.10 0.00 -0.06 0.00 0.00 57.16 57.74 1ytg n GLU 35 Cb 0.53 -2.53 -0.05 0.00 -0.06 0.00 0.00 31.44 29.33 1ytg n GLU 35 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1ytg s MET 36 N 4.26 1.10 -0.36 5.31 0.23 -1.26 -5.04 119.30 123.54 1ytg s MET 36 Ca 0.96 -0.88 -0.12 0.00 -1.03 0.00 0.00 55.69 54.62 1ytg s MET 36 Cb -0.78 0.44 0.00 0.00 -1.53 0.00 0.00 34.83 32.96 1ytg s MET 36 CO 0.54 -0.42 0.22 -0.80 -2.03 0.00 0.00 175.02 172.53 1ytg s ASN 37 N -2.86 5.86 0.26 -1.18 -0.87 -1.26 -5.05 114.94 109.84 1ytg s ASN 37 Ca 0.07 -0.70 0.08 0.00 -1.57 0.00 0.00 52.86 50.75 1ytg s ASN 37 Cb 0.02 -2.08 -0.04 0.00 -0.02 0.00 0.00 41.25 39.13 1ytg s ASN 37 CO -0.08 -0.31 0.09 -0.76 -2.57 0.00 0.00 177.10 173.48 1ytg s LEU 38 N 1.64 3.48 0.10 0.60 1.43 -1.26 -5.07 118.68 119.61 1ytg s LEU 38 Ca 0.04 -0.47 -0.24 0.00 -1.03 0.00 0.00 54.13 52.43 1ytg s LEU 38 Cb -0.18 -2.01 -0.07 0.00 0.03 0.00 0.00 46.19 43.96 1ytg s LEU 38 CO 0.08 -0.03 0.75 -2.16 0.23 0.00 0.00 176.35 175.22 1ytg s PRO 39 N -3.76 4.50 0.00 1.29 0.05 -1.26 -5.00 135.00 130.82 1ytg s PRO 39 Ca 0.32 1.07 0.00 0.00 0.05 0.00 0.00 61.00 62.44 1ytg s PRO 39 Cb -0.07 -3.31 0.00 0.00 0.05 0.00 0.00 34.50 31.17 1ytg s PRO 39 CO 0.22 0.44 0.00 0.41 0.05 0.00 0.00 177.00 178.13 1ytg n GLY 40 N 1.98 2.93 3.82 0.56 0.00 -1.26 -5.03 105.19 108.19 1ytg n GLY 40 Ca -0.05 -1.28 -0.33 0.00 0.00 0.00 0.00 46.02 44.36 1ytg n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ytg s LYS 41 N -2.14 3.86 0.04 1.61 3.01 -1.26 -5.07 119.74 119.80 1ytg s LYS 41 Ca 0.00 1.15 0.02 0.00 -1.01 0.00 0.00 55.97 56.14 1ytg s LYS 41 Cb 0.00 -2.12 -0.02 0.00 -1.01 0.00 0.00 37.83 34.68 1ytg s LYS 41 CO 0.00 -0.35 -0.08 1.67 0.51 0.00 0.00 175.35 177.10 1ytg s TRP 42 N -2.31 0.70 -0.10 3.18 1.48 -1.26 -4.66 118.94 115.97 1ytg s TRP 42 Ca 0.63 -0.47 -0.04 0.00 -1.06 0.00 0.00 56.10 55.16 1ytg s TRP 42 Cb -0.12 -0.42 -0.04 0.00 -1.16 0.00 0.00 33.47 31.73 1ytg s TRP 42 CO 0.25 -0.07 0.07 -1.59 -4.06 0.00 0.00 176.95 171.54 1ytg s LYS 43 N -1.49 3.19 0.35 3.25 0.00 -1.09 -4.90 119.74 119.05 1ytg s LYS 43 Ca -0.09 -0.29 -0.29 0.00 0.00 0.00 0.00 55.97 55.31 1ytg s LYS 43 Cb -0.09 -2.97 -0.11 0.00 0.00 0.00 0.00 37.83 34.65 1ytg s LYS 43 CO 0.00 0.74 1.49 -1.25 0.00 0.00 0.00 175.35 176.33 1ytg s PRO 44 N -0.98 4.15 0.09 1.78 0.04 -1.26 -0.51 135.00 138.31 1ytg s PRO 44 Ca 0.14 2.52 0.01 0.00 0.04 0.00 0.00 61.00 63.71 1ytg s PRO 44 Cb -0.12 -3.00 -0.04 0.00 0.04 0.00 0.00 34.50 31.38 1ytg s PRO 44 CO 0.03 -0.51 -0.05 0.21 0.04 0.00 0.00 177.00 176.73 1ytg s LYS 45 N -1.60 0.79 -0.07 4.56 2.20 -0.01 -4.84 119.74 120.76 1ytg s LYS 45 Ca 0.55 -1.32 0.04 0.00 -0.36 0.00 0.00 55.97 54.88 1ytg s LYS 45 Cb -0.46 -0.06 0.00 0.00 -1.51 0.00 0.00 37.83 35.80 1ytg s LYS 45 CO 0.57 -0.06 -0.18 -1.64 -0.36 0.00 0.00 175.35 173.68 1ytg s MET 46 N -3.87 2.21 0.33 4.03 -1.94 -1.26 -0.52 119.30 118.27 1ytg s MET 46 Ca 0.12 -0.64 0.03 0.00 -1.71 0.00 0.00 55.69 53.49 1ytg s MET 46 Cb 0.06 -1.77 -0.01 0.00 2.01 0.00 0.00 34.83 35.12 1ytg s MET 46 CO -0.06 0.15 0.12 0.44 -0.01 0.00 0.00 175.02 175.66 1ytg n ILE 47 N 3.50 0.00 -3.91 2.53 -5.35 0.06 -4.92 119.36 111.27 1ytg n ILE 47 Ca -0.20 -1.92 -0.09 0.00 -0.27 0.00 0.00 62.75 60.27 1ytg n ILE 47 Cb 0.52 0.69 -0.09 0.00 -1.74 0.00 0.00 39.64 39.02 1ytg n ILE 47 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1ytg s GLY 48 N -3.02 0.14 0.00 3.28 0.00 -1.26 -0.46 107.32 106.01 1ytg s GLY 48 Ca 0.17 -0.53 0.00 0.00 0.00 0.00 0.00 44.72 44.36 1ytg s GLY 48 CO 0.12 -0.68 0.00 0.61 0.00 0.00 0.00 173.10 173.15 1ytg n GLY 49 N 0.60 3.87 3.57 0.20 0.00 0.11 -4.89 105.19 108.65 1ytg n GLY 49 Ca -0.18 -1.23 -0.27 0.00 0.00 0.00 0.00 46.02 44.34 1ytg n GLY 49 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ytg s ILE 50 N -2.05 3.48 0.00 -0.61 -1.09 -1.26 0.01 121.20 119.68 1ytg s ILE 50 Ca 0.00 -0.71 0.00 0.00 -2.23 0.00 0.00 60.65 57.71 1ytg s ILE 50 Cb 0.00 -4.36 0.00 0.00 -1.58 0.00 0.00 42.46 36.52 1ytg s ILE 50 CO 0.00 -0.91 0.00 0.61 -1.23 0.00 0.00 174.94 173.41 1ytg n GLY 51 N 6.12 3.14 0.00 6.18 0.00 -1.26 -5.12 105.19 114.26 1ytg n GLY 51 Ca 0.43 -0.42 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1ytg n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ytg n GLY 52 N 0.00 0.59 3.76 -0.02 0.00 0.10 -5.09 105.19 104.54 1ytg n GLY 52 Ca 0.00 -1.93 -0.40 0.00 0.00 0.00 0.00 46.02 43.68 1ytg n GLY 52 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ytg s PHE 53 N -1.74 3.40 0.16 1.61 5.36 -1.26 0.04 117.98 125.55 1ytg s PHE 53 Ca 0.00 1.60 -0.15 0.00 -0.96 0.00 0.00 56.93 57.42 1ytg s PHE 53 Cb 0.00 -3.42 0.02 0.00 -0.34 0.00 0.00 43.02 39.28 1ytg s PHE 53 CO 0.00 -1.00 0.42 0.96 -1.46 0.00 0.00 175.22 174.14 1ytg s ILE 54 N -1.13 0.05 -0.16 3.12 -4.36 0.40 -4.93 121.20 114.19 1ytg s ILE 54 Ca 0.46 -0.86 -0.11 0.00 -0.26 0.00 0.00 60.65 59.89 1ytg s ILE 54 Cb -0.35 -1.49 -0.05 0.00 1.25 0.00 0.00 42.46 41.83 1ytg s ILE 54 CO 0.45 -0.24 0.19 -1.59 0.24 0.00 0.00 174.94 173.98 1ytg s LYS 55 N -3.87 4.05 0.33 0.37 0.00 -1.26 -0.76 119.74 118.59 1ytg s LYS 55 Ca 0.09 -0.09 0.03 0.00 0.00 0.00 0.00 55.97 56.00 1ytg s LYS 55 Cb 0.01 -3.37 -0.05 0.00 0.00 0.00 0.00 37.83 34.42 1ytg s LYS 55 CO -0.06 0.40 0.08 0.14 0.00 0.00 0.00 175.35 175.91 1ytg s VAL 56 N 0.05 0.93 -0.23 1.79 -7.23 0.32 -4.60 120.40 111.42 1ytg s VAL 56 Ca 0.12 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.23 1ytg s VAL 56 Cb -0.12 -2.66 -0.03 0.00 0.56 0.00 0.00 36.38 34.13 1ytg s VAL 56 CO 0.01 0.00 0.04 -0.13 -0.31 0.00 0.00 175.10 174.71 1ytg s ARG 57 N -3.88 3.62 -0.10 4.82 0.52 -0.43 -0.83 118.95 122.67 1ytg s ARG 57 Ca 0.34 -0.50 -0.15 0.00 -0.52 0.00 0.00 55.73 54.90 1ytg s ARG 57 Cb 0.07 -3.23 -0.05 0.00 0.52 0.00 0.00 34.95 32.27 1ytg s ARG 57 CO 0.15 -0.13 0.36 -1.14 0.02 0.00 0.00 175.30 174.56 1ytg s GLN 58 N 1.43 4.12 -0.11 3.54 0.74 0.34 -1.15 119.66 128.56 1ytg s GLN 58 Ca 0.05 0.27 0.04 0.00 0.05 0.00 0.00 55.36 55.76 1ytg s GLN 58 Cb -0.15 -3.35 0.00 0.00 1.10 0.00 0.00 33.01 30.62 1ytg s GLN 58 CO 0.02 0.39 -0.23 0.71 -0.55 0.00 0.00 175.29 175.64 1ytg s TYR 59 N -0.07 2.50 0.19 1.67 1.51 0.77 -2.67 117.35 121.24 1ytg s TYR 59 Ca 0.21 -1.07 -0.00 0.00 -1.01 0.00 0.00 57.07 55.20 1ytg s TYR 59 Cb -0.15 -1.68 -0.04 0.00 -0.11 0.00 0.00 41.96 39.98 1ytg s TYR 59 CO 0.08 -0.45 0.37 -0.51 -1.11 0.00 0.00 175.55 173.93 1ytg s ASP 60 N 0.46 6.38 -1.49 2.29 1.01 -1.26 -0.58 116.67 123.47 1ytg s ASP 60 Ca -0.16 0.36 -0.07 0.00 0.71 0.00 0.00 52.55 53.39 1ytg s ASP 60 Cb -0.17 -1.99 0.06 0.00 1.01 0.00 0.00 42.92 41.82 1ytg s ASP 60 CO 0.06 -0.02 0.65 0.00 0.21 0.00 0.00 175.17 176.08 1ytg n GLN 61 N -0.60 -3.89 -3.05 8.23 1.13 -1.18 -4.86 117.38 113.16 1ytg n GLN 61 Ca -0.05 0.46 -0.40 0.00 -1.94 0.00 0.00 57.00 55.07 1ytg n GLN 61 Cb 0.54 -4.94 -0.05 0.00 0.11 0.00 0.00 30.24 25.90 1ytg n GLN 61 CO 0.00 0.00 0.00 0.42 -1.44 0.00 0.00 177.06 176.04 1ytg s ILE 62 N -3.63 4.99 0.15 5.09 -1.09 0.37 -4.57 121.20 122.51 1ytg s ILE 62 Ca 0.32 1.45 -0.30 0.00 -2.23 0.00 0.00 60.65 59.88 1ytg s ILE 62 Cb -0.17 -4.04 -0.07 0.00 -1.58 0.00 0.00 42.46 36.61 1ytg s ILE 62 CO 0.88 0.28 1.05 -2.84 -1.23 0.00 0.00 174.94 173.09 1ytg s PRO 63 N 0.59 4.62 -0.01 2.79 0.02 -1.26 -1.07 135.00 140.68 1ytg s PRO 63 Ca 0.37 1.62 0.01 0.00 0.02 0.00 0.00 61.00 63.03 1ytg s PRO 63 Cb -0.18 -3.32 0.00 0.00 0.02 0.00 0.00 34.50 31.03 1ytg s PRO 63 CO 0.19 0.11 -0.04 0.08 -0.33 0.00 0.00 177.00 177.00 1ytg s VAL 64 N -0.09 0.37 -0.16 3.83 1.01 -0.38 -4.54 120.40 120.43 1ytg s VAL 64 Ca 0.49 -0.16 -0.04 0.00 0.00 0.00 0.00 61.98 62.27 1ytg s VAL 64 Cb -0.27 -0.34 -0.03 0.00 0.00 0.00 0.00 36.38 35.74 1ytg s VAL 64 CO 0.33 0.13 -0.03 -1.61 0.00 0.00 0.00 175.10 173.92 1ytg s GLU 65 N 0.15 3.68 -0.31 2.72 2.02 -0.28 -0.89 118.70 125.80 1ytg s GLU 65 Ca -0.01 -0.51 0.03 0.00 0.02 0.00 0.00 54.97 54.50 1ytg s GLU 65 Cb -0.05 -2.96 0.09 0.00 0.10 0.00 0.00 34.13 31.31 1ytg s GLU 65 CO -0.00 0.20 0.02 0.42 0.02 0.00 0.00 175.26 175.92 1ytg s ILE 66 N 0.47 2.02 -1.47 -1.63 1.01 0.10 -1.85 121.20 119.85 1ytg s ILE 66 Ca -0.03 -2.02 -0.12 0.00 0.00 0.00 0.00 60.65 58.48 1ytg s ILE 66 Cb -0.14 -2.42 0.06 0.00 0.01 0.00 0.00 42.46 39.97 1ytg s ILE 66 CO 0.03 -0.48 1.03 0.00 0.00 0.00 0.00 174.94 175.52 1ytg n GLY 68 N -1.79 0.52 3.65 0.00 0.00 -1.26 -5.00 105.19 101.30 1ytg n GLY 68 Ca 0.03 -0.22 -0.35 0.00 0.00 0.00 0.00 46.02 45.48 1ytg n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1ytg s HIS 69 N -1.84 3.23 -0.00 1.61 4.02 -0.62 -5.10 115.29 116.59 1ytg s HIS 69 Ca 0.00 0.10 -0.02 0.00 1.02 0.00 0.00 55.06 56.16 1ytg s HIS 69 Cb 0.00 -1.96 -0.04 0.00 -1.02 0.00 0.00 32.58 29.56 1ytg s HIS 69 CO 0.00 0.28 0.13 -1.59 1.02 0.00 0.00 174.74 174.58 1ytg s LYS 70 N -0.15 3.25 0.15 1.40 -2.85 -1.26 -0.73 119.74 119.56 1ytg s LYS 70 Ca 0.06 -0.41 0.07 0.00 -1.00 0.00 0.00 55.97 54.69 1ytg s LYS 70 Cb -0.12 -2.98 -0.04 0.00 -2.06 0.00 0.00 37.83 32.63 1ytg s LYS 70 CO 0.02 0.66 -0.14 0.00 0.10 0.00 0.00 175.35 175.98 1ytg s ALA 71 N -1.27 1.70 -0.07 0.59 0.00 -0.06 -4.78 121.76 117.87 1ytg s ALA 71 Ca 0.25 -1.44 -0.02 0.00 0.00 0.00 0.00 51.96 50.76 1ytg s ALA 71 Cb -0.12 -0.08 0.03 0.00 0.00 0.00 0.00 23.12 22.94 1ytg s ALA 71 CO 0.17 0.09 0.02 0.42 0.00 0.00 0.00 175.76 176.46 1ytg s ILE 72 N -2.46 0.20 -0.04 0.00 1.01 -1.26 -1.25 121.20 117.40 1ytg s ILE 72 Ca 0.14 0.20 -0.13 0.00 0.00 0.00 0.00 60.65 60.87 1ytg s ILE 72 Cb -0.03 -0.42 0.04 0.00 0.01 0.00 0.00 42.46 42.06 1ytg s ILE 72 CO 0.04 0.21 0.57 0.61 0.00 0.00 0.00 174.94 176.37 1ytg n GLY 73 N 5.20 0.26 3.77 6.18 0.00 -0.23 -4.81 105.19 115.56 1ytg n GLY 73 Ca -0.06 -0.89 -0.39 0.00 0.00 0.00 0.00 46.02 44.68 1ytg n GLY 73 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ytg s THR 74 N -2.00 2.59 -0.03 2.61 2.01 -1.26 -0.48 115.64 119.09 1ytg s THR 74 Ca 0.14 0.51 -0.01 0.00 0.31 0.00 0.00 61.69 62.64 1ytg s THR 74 Cb -0.00 -3.29 0.03 0.00 0.01 0.00 0.00 72.50 69.24 1ytg s THR 74 CO -0.01 0.06 0.05 -0.69 -0.69 0.00 0.00 174.62 173.34 1ytg s VAL 75 N -1.29 -0.05 -0.01 3.82 1.01 0.25 -4.59 120.40 119.54 1ytg s VAL 75 Ca 0.59 0.17 0.01 0.00 0.00 0.00 0.00 61.98 62.75 1ytg s VAL 75 Cb -0.38 -0.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.87 1ytg s VAL 75 CO 0.48 0.07 0.02 -0.76 0.00 0.00 0.00 175.10 174.91 1ytg s LEU 76 N 0.87 3.62 -0.10 3.92 1.43 -0.51 -0.17 118.68 127.75 1ytg s LEU 76 Ca -0.07 0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.09 1ytg s LEU 76 Cb -0.10 -2.07 0.02 0.00 0.03 0.00 0.00 46.19 44.06 1ytg s LEU 76 CO -0.03 0.28 -0.14 -0.69 0.23 0.00 0.00 176.35 176.00 1ytg s VAL 77 N -1.10 1.44 -0.01 -1.59 1.01 -0.30 -0.77 120.40 119.07 1ytg s VAL 77 Ca 0.20 -0.61 -0.04 0.00 0.00 0.00 0.00 61.98 61.54 1ytg s VAL 77 Cb -0.12 -1.32 0.01 0.00 0.00 0.00 0.00 36.38 34.96 1ytg s VAL 77 CO 0.11 0.43 0.17 0.61 0.00 0.00 0.00 175.10 176.41 1ytg n GLY 78 N 4.21 0.44 3.57 4.51 0.00 -0.21 -1.31 105.19 116.40 1ytg n GLY 78 Ca -0.19 -0.84 -0.36 0.00 0.00 0.00 0.00 46.02 44.63 1ytg n GLY 78 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ytg s PRO 79 N -2.00 3.27 -0.04 1.61 0.04 -1.26 -4.02 135.00 132.59 1ytg s PRO 79 Ca 0.04 -1.06 0.03 0.00 0.04 0.00 0.00 61.00 60.05 1ytg s PRO 79 Cb -0.00 -5.30 -0.03 0.00 0.04 0.00 0.00 34.50 29.21 1ytg s PRO 79 CO -0.00 -2.72 -0.12 -0.08 0.04 0.00 0.00 177.00 174.12 1ytg s THR 80 N 6.86 3.28 0.46 1.26 -1.32 -1.26 -5.01 115.64 119.91 1ytg s THR 80 Ca 0.56 -0.70 0.23 0.00 -1.21 0.00 0.00 61.69 60.58 1ytg s THR 80 Cb -0.01 -2.33 0.43 0.00 -1.51 0.00 0.00 72.50 69.08 1ytg s THR 80 CO -0.02 0.55 1.84 1.55 -2.21 0.00 0.00 174.62 176.33 1ytg h PRO 81 N 5.16 0.24 -2.36 7.08 0.13 -1.99 -3.44 132.00 136.82 1ytg h PRO 81 Ca -0.47 -0.01 -0.08 0.00 -0.87 0.00 0.00 66.00 64.56 1ytg h PRO 81 Cb 1.16 -0.06 -0.20 0.00 0.13 0.00 0.00 31.00 32.03 1ytg h PRO 81 CO 0.51 0.16 0.01 0.54 -0.23 0.00 0.00 178.00 178.99 1ytg s VAL 82 N -5.27 0.02 0.30 1.56 0.11 -1.26 -5.13 120.40 110.72 1ytg s VAL 82 Ca -0.07 -0.13 -0.29 0.00 -2.93 0.00 0.00 61.98 58.56 1ytg s VAL 82 Cb 0.23 -0.85 -0.10 0.00 -1.53 0.00 0.00 36.38 34.13 1ytg s VAL 82 CO 0.79 -0.07 1.37 0.20 -3.33 0.00 0.00 175.10 174.06 1ytg s ASN 83 N -0.83 6.69 0.03 3.54 0.01 -1.26 -4.87 114.94 118.26 1ytg s ASN 83 Ca -0.09 2.71 0.03 0.00 -0.71 0.00 0.00 52.86 54.80 1ytg s ASN 83 Cb -0.02 -2.64 -0.02 0.00 0.41 0.00 0.00 41.25 38.98 1ytg s ASN 83 CO 0.06 -0.62 -0.08 0.27 -1.51 0.00 0.00 177.10 175.21 1ytg s ILE 84 N -0.73 0.63 -0.30 0.60 -4.36 -0.87 -0.70 121.20 115.48 1ytg s ILE 84 Ca 0.53 -0.83 -0.10 0.00 -0.26 0.00 0.00 60.65 59.99 1ytg s ILE 84 Cb -0.41 -0.63 -0.02 0.00 1.25 0.00 0.00 42.46 42.65 1ytg s ILE 84 CO 0.50 -0.16 0.16 -0.63 0.24 0.00 0.00 174.94 175.06 1ytg s ILE 85 N -0.91 4.84 0.49 8.37 -1.09 0.57 -2.49 121.20 130.99 1ytg s ILE 85 Ca -0.04 -0.21 0.02 0.00 -2.23 0.00 0.00 60.65 58.19 1ytg s ILE 85 Cb -0.07 -3.40 0.09 0.00 -1.58 0.00 0.00 42.46 37.50 1ytg s ILE 85 CO 0.00 0.14 0.68 0.61 -1.23 0.00 0.00 174.94 175.14 1ytg n GLY 86 N 5.01 1.04 0.29 6.18 0.00 -1.18 -2.11 105.19 114.41 1ytg n GLY 86 Ca -0.14 -2.06 0.14 0.00 0.00 0.00 0.00 46.02 43.96 1ytg n GLY 86 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1ytg h ARG 87 N 0.00 0.00 -0.56 1.61 3.08 -0.98 -1.67 114.38 115.85 1ytg h ARG 87 Ca -0.22 0.00 0.07 0.00 0.07 0.00 0.00 59.98 59.89 1ytg h ARG 87 Cb 0.88 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.90 1ytg h ARG 87 CO 0.26 0.04 0.38 -2.95 -1.07 0.00 0.00 179.97 176.62 1ytg h ASN 88 N 0.00 0.44 0.00 7.04 -1.07 -1.71 -1.41 115.58 118.88 1ytg h ASN 88 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.37 1ytg h ASN 88 Cb 0.10 -0.09 0.00 0.00 -2.07 0.00 0.00 38.32 36.26 1ytg h ASN 88 CO 0.00 0.29 -1.27 0.18 0.07 0.00 0.00 177.43 176.70 1ytg n LEU 89 N -4.47 0.20 0.15 6.14 4.77 -0.96 -4.22 117.00 118.61 1ytg n LEU 89 Ca 0.08 -0.17 0.02 0.00 -0.03 0.00 0.00 56.01 55.91 1ytg n LEU 89 Cb 0.26 0.00 0.21 0.00 -2.33 0.00 0.00 43.42 41.56 1ytg n LEU 89 CO 0.34 0.05 0.55 -0.07 -1.33 0.00 0.00 177.39 176.93 1ytg h LEU 90 N 0.00 0.00 -0.46 2.23 3.38 -0.68 -2.95 115.31 116.82 1ytg h LEU 90 Ca 0.00 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.85 1ytg h LEU 90 Cb 0.50 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 1ytg h LEU 90 CO 0.00 0.53 -0.19 0.71 0.09 0.00 0.00 178.44 179.58 1ytg h THR 91 N 0.00 1.27 -0.39 0.22 1.35 -1.48 -0.92 112.91 112.97 1ytg h THR 91 Ca -0.01 -1.35 0.02 0.00 -0.55 0.00 0.00 66.41 64.52 1ytg h THR 91 Cb 1.07 1.15 -0.02 0.00 -1.73 0.00 0.00 68.15 68.63 1ytg h THR 91 CO 0.07 0.46 0.26 1.56 -0.25 0.00 0.00 175.52 177.62 1ytg h GLN 92 N 0.80 0.45 -0.30 4.72 4.20 -1.69 0.90 115.11 124.18 1ytg h GLN 92 Ca 0.11 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.79 1ytg h GLN 92 Cb 0.77 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.44 1ytg h GLN 92 CO 0.06 0.30 0.00 0.44 -0.67 0.00 0.00 178.83 178.96 1ytg n ILE 93 N -4.48 0.38 -2.65 2.54 -5.35 -1.14 -4.95 119.36 103.71 1ytg n ILE 93 Ca 0.03 -0.57 -0.06 0.00 -0.27 0.00 0.00 62.75 61.88 1ytg n ILE 93 Cb 0.11 0.70 0.02 0.00 -1.74 0.00 0.00 39.64 38.73 1ytg n ILE 93 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1ytg n GLY 94 N 1.34 0.45 3.74 3.28 0.00 0.31 -5.00 105.19 109.31 1ytg n GLY 94 Ca 0.18 -0.47 -0.41 0.00 0.00 0.00 0.00 46.02 45.32 1ytg n GLY 94 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ytg s THR 96 N -0.49 1.34 0.04 0.00 -4.23 -1.26 -4.79 115.64 106.25 1ytg s THR 96 Ca 0.45 -2.01 -0.10 0.00 -1.18 0.00 0.00 61.69 58.85 1ytg s THR 96 Cb -0.26 -1.81 -0.06 0.00 1.34 0.00 0.00 72.50 71.72 1ytg s THR 96 CO 0.32 -0.63 0.37 -0.76 -0.54 0.00 0.00 174.62 173.38 1ytg s LEU 97 N -3.01 4.38 -0.07 4.79 1.43 -1.26 -5.09 118.68 119.84 1ytg s LEU 97 Ca 0.16 0.78 -0.08 0.00 -1.03 0.00 0.00 54.13 53.96 1ytg s LEU 97 Cb -0.00 -2.80 0.02 0.00 0.03 0.00 0.00 46.19 43.43 1ytg s LEU 97 CO 0.03 0.23 0.22 0.20 0.23 0.00 0.00 176.35 177.25 1ytg s ASN 98 N -1.56 -0.21 0.00 2.29 0.01 -1.26 -5.29 114.94 108.92 1ytg s ASN 98 Ca 0.29 0.38 0.00 0.00 -0.71 0.00 0.00 52.86 52.83 1ytg s ASN 98 Cb -0.14 0.43 0.00 0.00 0.41 0.00 0.00 41.25 41.94 1ytg s ASN 98 CO 0.16 -0.11 0.00 2.22 -1.51 0.00 0.00 177.10 177.86